N-(4-methoxyphenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide Openeye Name: N-(4-methoxyphenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide CAS Name: N-(4-methoxyphenyl)-1-(7H-purin-6-yl)-4-piperidinecarboxamide IUPAC Name: N-(4-methoxyphenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide Traditional Name: N-(4-methoxyphenyl)-1-(7H-purin-6-yl)isonipecotamide Formula: C18H20N6O2 MolecularWeight: 352.3904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=NC4=C3NC=N4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C18H20N6O2/c1-26-14-4-2-13(3-5-14)23-18(25)12-6-8-24(9-7-12)17-15-16(20-10-19-15)21-11-22-17/h2-5,10-12H,6-9H2,1H3,(H,23,25)(H,19,20,21,22)